{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-tetragonal-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P4_2/mnm" } "basis-atom-coordinates" { "source-value" [ [ 0 0 0.5 ] [ 0.5 0.5 0 ] [ 0.084938 0.337263 0 ] [ 0.837263 0.415062 0.5 ] [ 0.162737 0.584938 0.5 ] [ 0.915062 0.662737 0 ] [ 0.415062 0.837263 0.5 ] [ 0.584938 0.162737 0.5 ] [ 0.337263 0.084938 0 ] [ 0.662737 0.915062 0 ] [ 0.779464 0.220536 0 ] [ 0.720536 0.720536 0.5 ] [ 0.279464 0.279464 0.5 ] [ 0.220536 0.779464 0 ] ] } "species" { "source-value" [ "Tb" "Tb" "Ni" "Ni" "Ni" "Ni" "Ni" "Ni" "Ni" "Ni" "P" "P" "P" "P" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 7.10414607 "source-unit" "angstrom" } "c" { "source-value" 3.60162393 "source-unit" "angstrom" } }